Glycoside
GD012107
Name:
NoneFormula:
C9H13O4N5Smiles:
OC[C@H](O)[C@H](O)[C@H](O)c1c[nH]c(-c2nc[nH]n2)n1Aglycone:
c1c[nH]c(-c2nc[nH]n2)n1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -2.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 255.23 | Num_heavy_atoms: | 18 |
| TPSA: | 151.17 | NumAromaticRings: | 2 |
Unique Aglycone
AD09147
Formula: C5H5N5
Smiles:
c1c[nH]c(-c2nc[nH]n2)n1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 1 |
| MolWt: | 135.13 | Num_heavy_atoms: | 10 |
| TPSA: | 70.25 | NumAromaticRings: | 2 |
